N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine

C14H23N3 — CID 60877562

IUPACN'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine
SMILESCc1cccc(N(CCCN)C2CCCC2)n1
InChIInChI=1S/C14H23N3/c1-12-6-4-9-14(16-12)17(11-5-10-15)13-7-2-3-8-13/h4,6,9,13H,2-3,5,7-8,10-11,15H2,1H3
InChIKeyUYXOHAJJKVGXQF-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.49
Rot. Bonds5

About N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine

N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine (PubChem CID 60877562) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine
PubChem CID60877562
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine
SMILESCc1cccc(N(CCCN)C2CCCC2)n1
InChIInChI=1S/C14H23N3/c1-12-6-4-9-14(16-12)17(11-5-10-15)13-7-2-3-8-13/h4,6,9,13H,2-3,5,7-8,10-11,15H2,1H3
InChIKeyUYXOHAJJKVGXQF-UHFFFAOYSA-N
XLogP2.49
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclohexyl-N'-(2,6-dimethylpyrimidin-4-yl)propane-1,3-diamine
CID 54939100
N'-cyclobutyl-N'-pyridin-2-ylpropane-1,3-diamine
CID 102874472
N'-cyclobutyl-N'-(6-ethoxy-2-methylpyrimidin-4-yl)propane-1,3-diamine
CID 102874546
N'-cyclopropyl-N'-(2-methylpyrimidin-4-yl)propane-1,3-diamine
CID 62785297
N-cyclohexyl-N,6-dimethylpyridin-2-amine
CID 133313190
N-cyclobutyl-N,6-dimethylpyridin-2-amine
CID 130668195
N'-cyclobutyl-N'-(4-methyl-1,3-thiazol-2-yl)propane-1,3-diamine
CID 102874488
3-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclobutylamino]propan-1-ol
CID 102859672
N'-cyclohexyl-N'-(3-methoxyphenyl)propane-1,3-diamine
CID 43319153
2-[3-aminopropyl(cyclopentyl)amino]-4,6-dimethylpyridine-3-carboxamide
CID 60868730
2-[cyclopropyl-(6-methyl-2-pyridinyl)amino]acetic acid
CID 83833314
N'-cyclohexyl-N'-pyridin-4-ylpropane-1,3-diamine
CID 43137168

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine?
The IUPAC name of N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine (CID 60877562) is N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine is Cc1cccc(N(CCCN)C2CCCC2)n1.
What is the InChIKey of N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine?
The InChIKey is UYXOHAJJKVGXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-12-6-4-9-14(16-12)17(11-5-10-15)13-7-2-3-8-13/h4,6,9,13H,2-3,5,7-8,10-11,15H2,1H3.
What are the key properties of N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine?
N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine has a molecular weight of 233.36 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(6-methyl-2-pyridinyl)propane-1,3-diamine is sourced from PubChem (CID 60877562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).