4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide

C15H26N4O — CID 115310147

IUPAC4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide
SMILESCC(C)CC(C)(CN)Nc1ccnc(C(=O)N(C)C)c1
InChIInChI=1S/C15H26N4O/c1-11(2)9-15(3,10-16)18-12-6-7-17-13(8-12)14(20)19(4)5/h6-8,11H,9-10,16H2,1-5H3,(H,17,18)
InChIKeyMGSPKKQATGWOJN-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.96
Rot. Bonds6

About 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide

4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide (PubChem CID 115310147) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide
PubChem CID115310147
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide
SMILESCC(C)CC(C)(CN)Nc1ccnc(C(=O)N(C)C)c1
InChIInChI=1S/C15H26N4O/c1-11(2)9-15(3,10-16)18-12-6-7-17-13(8-12)14(20)19(4)5/h6-8,11H,9-10,16H2,1-5H3,(H,17,18)
InChIKeyMGSPKKQATGWOJN-UHFFFAOYSA-N
XLogP1.96
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-amino-2-methylpropyl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 113282785
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771
4-(4-aminobutan-2-ylamino)-N,N-dimethylpyridine-2-carboxamide
CID 83180429
4-[(1-methoxy-2-methylpropan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 113470431
4-[(1-amino-4-methylpentan-3-yl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 106357616
N,N-dimethyl-4-[2-[methyl(propan-2-yl)amino]ethylamino]pyridine-2-carboxamide
CID 62642740
4-[(2-hydroxy-2-methylbutyl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 63962759
4-(2-cyclopropylpropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 115620851
4-(tert-butylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109202921
N,N-dimethyl-4-[[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxamide
CID 43395819
4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43517479
4-(1-hydroxybutan-2-ylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395737

Frequently Asked Questions

What is the IUPAC name of 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide?
The IUPAC name of 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide (CID 115310147) is 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide?
The canonical SMILES for 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide is CC(C)CC(C)(CN)Nc1ccnc(C(=O)N(C)C)c1.
What is the InChIKey of 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide?
The InChIKey is MGSPKKQATGWOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)9-15(3,10-16)18-12-6-7-17-13(8-12)14(20)19(4)5/h6-8,11H,9-10,16H2,1-5H3,(H,17,18).
What are the key properties of 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide?
4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-amino-2,4-dimethylpentan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 115310147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).