2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide

C14H24N4O — CID 119888018

IUPAC2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide
SMILESCCCC(N)C(=O)NCCCNc1ccc(C)cn1
InChIInChI=1S/C14H24N4O/c1-3-5-12(15)14(19)17-9-4-8-16-13-7-6-11(2)10-18-13/h6-7,10,12H,3-5,8-9,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyHWTLOXCNRZRNLP-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.44
Rot. Bonds8

About 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide

2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide (PubChem CID 119888018) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide
PubChem CID119888018
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide
SMILESCCCC(N)C(=O)NCCCNc1ccc(C)cn1
InChIInChI=1S/C14H24N4O/c1-3-5-12(15)14(19)17-9-4-8-16-13-7-6-11(2)10-18-13/h6-7,10,12H,3-5,8-9,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyHWTLOXCNRZRNLP-UHFFFAOYSA-N
XLogP1.44
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]-3-phenylpropanamide
CID 119888012
2-amino-3-methyl-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide;dihydrochloride
CID 119888065
4-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide;dihydrochloride
CID 120565647
2-amino-N-[3-(4-methyl-2-nitroanilino)propyl]pentanamide;hydrochloride
CID 119332475
(2R)-2-amino-N-butylpentanamide
CID 82668431
2-(aminomethyl)-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119888059
(2R)-3-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methyl-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]propanamide
CID 97071138
2-amino-5-methoxy-N-(5-methyl-2-pyridinyl)pentanamide
CID 81080952
N-(4-chloropentyl)-5-methylpyridin-2-amine
CID 106124548
2-[(5-methyl-2-pyridinyl)amino]-N-propylpropanamide
CID 61480003
2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]acetamide
CID 124749664
2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]acetamide
CID 124749663

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide?
The IUPAC name of 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide (CID 119888018) is 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide.
What is the SMILES notation for 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide?
The canonical SMILES for 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide is CCCC(N)C(=O)NCCCNc1ccc(C)cn1.
What is the InChIKey of 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide?
The InChIKey is HWTLOXCNRZRNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-5-12(15)14(19)17-9-4-8-16-13-7-6-11(2)10-18-13/h6-7,10,12H,3-5,8-9,15H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide?
2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide has a molecular weight of 264.37 g/mol, XLogP of 1.44, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]pentanamide is sourced from PubChem (CID 119888018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).