[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone

C20H25N5O2 — CID 134707137

IUPAC[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCc1nc(CNc2ccc(C(=O)N3CCOCC3)cn2)nc2c1CCCC2
InChIInChI=1S/C20H25N5O2/c1-14-16-4-2-3-5-17(16)24-19(23-14)13-22-18-7-6-15(12-21-18)20(26)25-8-10-27-11-9-25/h6-7,12H,2-5,8-11,13H2,1H3,(H,21,22)
InChIKeyWYJFCQTXOPLBBS-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.14
Rot. Bonds4

About [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone

[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 134707137) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID134707137
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCc1nc(CNc2ccc(C(=O)N3CCOCC3)cn2)nc2c1CCCC2
InChIInChI=1S/C20H25N5O2/c1-14-16-4-2-3-5-17(16)24-19(23-14)13-22-18-7-6-15(12-21-18)20(26)25-8-10-27-11-9-25/h6-7,12H,2-5,8-11,13H2,1H3,(H,21,22)
InChIKeyWYJFCQTXOPLBBS-UHFFFAOYSA-N
XLogP2.14
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone with MolForge

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Related Compounds

[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134700458
(6-hydrazinyl-3-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 62968732
morpholin-4-yl-[4-[[[5-(trifluoromethyl)-2-pyridinyl]amino]methyl]phenyl]methanone
CID 33383192
[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 135100948
morpholin-4-yl-[6-(2-pyrazol-1-ylethylamino)-3-pyridinyl]methanone
CID 134700155
[6-(propylamino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 60722911
azepan-1-yl-[6-(1,3-benzodioxol-5-ylmethylamino)-3-pyridinyl]methanone
CID 109157408
[6-[2-(1-methylsulfonylpiperidin-2-yl)ethylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 135111126
N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]-1-(2-morpholin-4-ylethyl)triazole-4-carboxamide
CID 56855023
[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 4582787
azepan-1-yl-[6-(propylamino)-3-pyridinyl]methanone
CID 62172577
[6-(3,5-dichloroanilino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153503

Frequently Asked Questions

What is the IUPAC name of [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone (CID 134707137) is [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone is Cc1nc(CNc2ccc(C(=O)N3CCOCC3)cn2)nc2c1CCCC2.
What is the InChIKey of [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is WYJFCQTXOPLBBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-14-16-4-2-3-5-17(16)24-19(23-14)13-22-18-7-6-15(12-21-18)20(26)25-8-10-27-11-9-25/h6-7,12H,2-5,8-11,13H2,1H3,(H,21,22).
What are the key properties of [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 367.45 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 134707137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).