4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine

C15H23N5 — CID 171782266

IUPAC4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine
SMILESCCCCC(C)(CN)Nc1cc(N)nc2cccnc12
InChIInChI=1S/C15H23N5/c1-3-4-7-15(2,10-16)20-12-9-13(17)19-11-6-5-8-18-14(11)12/h5-6,8-9H,3-4,7,10,16H2,1-2H3,(H3,17,19,20)
InChIKeyNLCPXXZCRFJAFL-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.53
Rot. Bonds6

About 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine

4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine (PubChem CID 171782266) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine.

Molecular Properties

Compound Name4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine
PubChem CID171782266
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine
SMILESCCCCC(C)(CN)Nc1cc(N)nc2cccnc12
InChIInChI=1S/C15H23N5/c1-3-4-7-15(2,10-16)20-12-9-13(17)19-11-6-5-8-18-14(11)12/h5-6,8-9H,3-4,7,10,16H2,1-2H3,(H3,17,19,20)
InChIKeyNLCPXXZCRFJAFL-UHFFFAOYSA-N
XLogP2.53
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[(2-amino-1,5-naphthyridin-4-yl)amino]-2-methylhexyl]cyclopropanecarboxamide
CID 162680445
4-N-(3-methylheptan-3-yl)pyrido[3,2-d]pyrimidine-2,4-diamine
CID 122598680
4-N-benzyl-1,5-naphthyridine-2,4-diamine
CID 91308709
(2R)-2-[[2-amino-7-[2-(diethylamino)pyrimidin-5-yl]-1,5-naphthyridin-4-yl]amino]-2-methylhexan-1-ol
CID 162680433
N-[(2R)-2-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-2-methylhexyl]acetamide
CID 122599112
4-N-[(3S)-3-methylhexan-3-yl]pyrido[3,2-d]pyrimidine-2,4-diamine
CID 122598693
N-[2-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-2-methylheptyl]acetamide
CID 122585361
2-[[2-amino-7-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,5-naphthyridin-4-yl]amino]-2-methylhexan-1-ol
CID 175339483
2-N-(2-fluorophenyl)-2-methyloctane-1,2-diamine
CID 65376902
N-[2-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-2-methylhexyl]-1,2-oxazole-3-carboxamide
CID 175478859
N-[(2R)-2-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-2-methylhexyl]-1-methyl-1,2,4-triazole-3-carboxamide
CID 169102407
(3S)-3-[(2-chloropyrido[3,2-d]pyrimidin-4-yl)amino]-3-methylheptan-2-ol
CID 122585247

Frequently Asked Questions

What is the IUPAC name of 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine?
The IUPAC name of 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine (CID 171782266) is 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine.
What is the SMILES notation for 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine?
The canonical SMILES for 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine is CCCCC(C)(CN)Nc1cc(N)nc2cccnc12.
What is the InChIKey of 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine?
The InChIKey is NLCPXXZCRFJAFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-3-4-7-15(2,10-16)20-12-9-13(17)19-11-6-5-8-18-14(11)12/h5-6,8-9H,3-4,7,10,16H2,1-2H3,(H3,17,19,20).
What are the key properties of 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine?
4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine has a molecular weight of 273.38 g/mol, XLogP of 2.53, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine is sourced from PubChem (CID 171782266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).