2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride

C14H28ClN5 — CID 54606444

IUPAC2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride
SMILESCCN(CC)CCCC(C)Nc1nccc(N)c1N.Cl
InChIInChI=1S/C14H27N5.ClH/c1-4-19(5-2)10-6-7-11(3)18-14-13(16)12(15)8-9-17-14;/h8-9,11H,4-7,10,16H2,1-3H3,(H3,15,17,18);1H
InChIKeyJZGKNHCMPOVBMX-UHFFFAOYSA-N
MW301.87 g/mol
LogP2.59
Rot. Bonds8

About 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride

2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride (PubChem CID 54606444) has the molecular formula C14H28ClN5 and a molecular weight of 301.87 g/mol. Its IUPAC name is 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride.

Molecular Properties

Compound Name2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride
PubChem CID54606444
Molecular FormulaC14H28ClN5
Molecular Weight301.87 g/mol
Exact Mass301.20
IUPAC Name2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride
SMILESCCN(CC)CCCC(C)Nc1nccc(N)c1N.Cl
InChIInChI=1S/C14H27N5.ClH/c1-4-19(5-2)10-6-7-11(3)18-14-13(16)12(15)8-9-17-14;/h8-9,11H,4-7,10,16H2,1-3H3,(H3,15,17,18);1H
InChIKeyJZGKNHCMPOVBMX-UHFFFAOYSA-N
XLogP2.59
TPSA80.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.87
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-4-N-[5-(diethylamino)pentan-2-yl]pyrimidine-4,5-diamine
CID 55143692
2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,5-diamine
CID 43115432
3-bromo-2-N-[5-(diethylamino)pentan-2-yl]-4-methylpyridine-2,5-diamine
CID 104506257
3-bromo-2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,5-diamine
CID 79532522
(4R)-1-N,1-N-diethyl-4-N-pyridin-2-ylpentane-1,4-diamine
CID 40545835
2,6-dichloro-1-N-[5-(diethylamino)pentan-2-yl]benzene-1,4-diamine
CID 106889815
4-N-[5-(diethylamino)pentan-2-yl]-2-N,2-N-dimethylpyrimidine-2,4-diamine
CID 64831242
4-N-[(2S)-5-(diethylamino)pentan-2-yl]quinoline-4,6-diamine
CID 129362155
1-N,1-N-diethyl-4-N-(5-methyl-2-pyridinyl)pentane-1,4-diamine
CID 43095595
1-N,1-N-diethyl-4-N-[4-(trifluoromethyl)pyrimidin-2-yl]pentane-1,4-diamine
CID 60732509
2-N-[5-(diethylamino)pentan-2-yl]-3-nitropyridine-2,6-diamine
CID 80772125
4-N-(2,5-dichloropyrimidin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine
CID 79633492

Frequently Asked Questions

What is the IUPAC name of 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride?
The IUPAC name of 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride (CID 54606444) is 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride.
What is the SMILES notation for 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride?
The canonical SMILES for 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride is CCN(CC)CCCC(C)Nc1nccc(N)c1N.Cl.
What is the InChIKey of 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride?
The InChIKey is JZGKNHCMPOVBMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5.ClH/c1-4-19(5-2)10-6-7-11(3)18-14-13(16)12(15)8-9-17-14;/h8-9,11H,4-7,10,16H2,1-3H3,(H3,15,17,18);1H.
What are the key properties of 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride?
2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride has a molecular weight of 301.87 g/mol, XLogP of 2.59, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[5-(diethylamino)pentan-2-yl]pyridine-2,3,4-triamine;hydrochloride is sourced from PubChem (CID 54606444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).