2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine

C13H21N3 — CID 83822265

IUPAC2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine
SMILESCC(CN)N(c1cccnc1)C1CCCC1
InChIInChI=1S/C13H21N3/c1-11(9-14)16(12-5-2-3-6-12)13-7-4-8-15-10-13/h4,7-8,10-12H,2-3,5-6,9,14H2,1H3
InChIKeyIEFZSQVIFMKGTG-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.18
Rot. Bonds4

About 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine

2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine (PubChem CID 83822265) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine
PubChem CID83822265
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine
SMILESCC(CN)N(c1cccnc1)C1CCCC1
InChIInChI=1S/C13H21N3/c1-11(9-14)16(12-5-2-3-6-12)13-7-4-8-15-10-13/h4,7-8,10-12H,2-3,5-6,9,14H2,1H3
InChIKeyIEFZSQVIFMKGTG-UHFFFAOYSA-N
XLogP2.18
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(oxetan-3-yl)-2-N-pyrimidin-5-ylpropane-1,2-diamine
CID 112709154
2-N-cyclopentyl-2-N-propan-2-ylpropane-1,2-diamine
CID 83817405
N-cyclopropyl-N-propyl-1-pyridin-3-ylethane-1,2-diamine
CID 43270152
2-[cyclopentyl(pyridin-3-yl)amino]acetic acid
CID 83822381
2-N-propan-2-yl-2-N-(pyridin-3-ylmethyl)propane-1,2-diamine
CID 112709140
1-amino-4-cyclopropyl-2-pyridin-3-ylpentan-3-ol
CID 83149883
N-methyl-N-piperidin-3-ylpyridin-3-amine
CID 83698004
2-(2,6-dimethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 82041284
N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
CID 55242009
N-cyclopentyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81248504
2-N-methyl-2-N-(2-pyridin-3-ylethyl)propane-1,2-diamine
CID 112708855
2-cyclobutyloxy-2-pyridin-3-ylethanamine
CID 62115429

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine?
The IUPAC name of 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine (CID 83822265) is 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine?
The canonical SMILES for 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine is CC(CN)N(c1cccnc1)C1CCCC1.
What is the InChIKey of 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine?
The InChIKey is IEFZSQVIFMKGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-11(9-14)16(12-5-2-3-6-12)13-7-4-8-15-10-13/h4,7-8,10-12H,2-3,5-6,9,14H2,1H3.
What are the key properties of 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine?
2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine has a molecular weight of 219.33 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopentyl-2-N-pyridin-3-ylpropane-1,2-diamine is sourced from PubChem (CID 83822265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).