4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide

C18H25N5O — CID 155952674

IUPAC4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide
SMILESCCN1CCC(N(C)C(=O)c2ccc3c(N)ncnc3c2)CC1C
InChIInChI=1S/C18H25N5O/c1-4-23-8-7-14(9-12(23)2)22(3)18(24)13-5-6-15-16(10-13)20-11-21-17(15)19/h5-6,10-12,14H,4,7-9H2,1-3H3,(H2,19,20,21)
InChIKeyGCXZHYLLCUAIKR-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.16
Rot. Bonds3

About 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide

4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide (PubChem CID 155952674) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide
PubChem CID155952674
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide
SMILESCCN1CCC(N(C)C(=O)c2ccc3c(N)ncnc3c2)CC1C
InChIInChI=1S/C18H25N5O/c1-4-23-8-7-14(9-12(23)2)22(3)18(24)13-5-6-15-16(10-13)20-11-21-17(15)19/h5-6,10-12,14H,4,7-9H2,1-3H3,(H2,19,20,21)
InChIKeyGCXZHYLLCUAIKR-UHFFFAOYSA-N
XLogP2.16
TPSA75.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-aminoquinazolin-7-yl)-[(3S,4S)-3-(dimethylamino)-4-hydroxypyrrolidin-1-yl]methanone
CID 154746243
6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide
CID 60724487
1-[(2S,4S)-1-ethyl-2-methylpiperidin-4-yl]-1-methyl-3-quinolin-8-ylurea
CID 95784277
5-amino-N-(1-benzyl-2-methylpiperidin-4-yl)-N,2-dimethylbenzamide
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2-[[(2S,4S)-1-ethyl-2-methylpiperidin-4-yl]-methylamino]-N-[(5-methylthiophen-2-yl)methyl]acetamide
CID 95981462
3-amino-N-(1-ethylpiperidin-4-yl)-4-fluoro-N-methylbenzamide
CID 43574421
3-(4-chloro-2-fluorophenyl)-1-[(2S,4S)-1-ethyl-2-methylpiperidin-4-yl]-1-methylurea
CID 95972892
N-methyl-N-(1-methylpiperidin-4-yl)-2H-benzotriazole-5-carboxamide
CID 110468852
2-amino-1-butyl-N-cyclohexyl-N-methylbenzimidazole-5-carboxamide
CID 59083098
N-(3-hydroxycyclohexyl)-N-methyl-2,1,3-benzoxadiazole-5-carboxamide
CID 67387541
N-(1-ethylazepan-4-yl)-N,1-dimethyl-2-pyrrolidin-1-ylbenzimidazole-5-carboxamide
CID 23630175
(2S)-2-amino-N-[(2R,4R)-1-benzyl-2-methylpiperidin-4-yl]-N-methylbutanamide
CID 124604392

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide?
The IUPAC name of 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide (CID 155952674) is 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide.
What is the SMILES notation for 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide?
The canonical SMILES for 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide is CCN1CCC(N(C)C(=O)c2ccc3c(N)ncnc3c2)CC1C.
What is the InChIKey of 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide?
The InChIKey is GCXZHYLLCUAIKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-4-23-8-7-14(9-12(23)2)22(3)18(24)13-5-6-15-16(10-13)20-11-21-17(15)19/h5-6,10-12,14H,4,7-9H2,1-3H3,(H2,19,20,21).
What are the key properties of 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide?
4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethyl-2-methylpiperidin-4-yl)-N-methylquinazoline-7-carboxamide is sourced from PubChem (CID 155952674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).