[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone

C15H24N4O — CID 81236525

IUPAC[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone
SMILESCCCN1CCN(C(=O)c2cnc(C)cc2NC)CC1
InChIInChI=1S/C15H24N4O/c1-4-5-18-6-8-19(9-7-18)15(20)13-11-17-12(2)10-14(13)16-3/h10-11H,4-9H2,1-3H3,(H,16,17)
InChIKeyKBTJDLQFSYFKSO-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.60
Rot. Bonds4

About [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone

[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone (PubChem CID 81236525) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone
PubChem CID81236525
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone
SMILESCCCN1CCN(C(=O)c2cnc(C)cc2NC)CC1
InChIInChI=1S/C15H24N4O/c1-4-5-18-6-8-19(9-7-18)15(20)13-11-17-12(2)10-14(13)16-3/h10-11H,4-9H2,1-3H3,(H,16,17)
InChIKeyKBTJDLQFSYFKSO-UHFFFAOYSA-N
XLogP1.60
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[6-methyl-4-(methylamino)-3-pyridinyl]-(4-methylsulfonylpiperazin-1-yl)methanone
CID 81237800
[6-methyl-4-(methylamino)-3-pyridinyl]-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 81243142
[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylazepan-1-yl)methanone
CID 81235678
[5-chloro-2-(methylamino)phenyl]-(4-propylpiperazin-1-yl)methanone
CID 62171773
1-[6-methyl-4-(methylamino)pyridine-3-carbonyl]-1,4-diazepan-5-one
CID 81241104
[6-methyl-4-(methylamino)-3-pyridinyl]-(3-propoxypiperidin-1-yl)methanone
CID 81238498
(4-amino-6-methyl-3-pyridinyl)-(4-ethylpiperazin-1-yl)methanone
CID 81236941
3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl-[6-methyl-4-(methylamino)-3-pyridinyl]methanone
CID 81238240
[6-methyl-4-(methylamino)-3-pyridinyl]-(2-methyl-1,4-oxazepan-4-yl)methanone
CID 81241168
6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide
CID 81234798
(6-methyl-3-pyridinyl)-(4-propyl-1,4-diazepan-1-yl)methanone
CID 56822431
[2-(hydroxymethyl)pyrrolidin-1-yl]-[6-methyl-4-(methylamino)-3-pyridinyl]methanone
CID 81240172

Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone?
The IUPAC name of [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone (CID 81236525) is [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone.
What is the SMILES notation for [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone?
The canonical SMILES for [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone is CCCN1CCN(C(=O)c2cnc(C)cc2NC)CC1.
What is the InChIKey of [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone?
The InChIKey is KBTJDLQFSYFKSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-5-18-6-8-19(9-7-18)15(20)13-11-17-12(2)10-14(13)16-3/h10-11H,4-9H2,1-3H3,(H,16,17).
What are the key properties of [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone?
[6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-4-(methylamino)-3-pyridinyl]-(4-propylpiperazin-1-yl)methanone is sourced from PubChem (CID 81236525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).