(2-pent-3-ynylcyclopentyl)methanamine

C11H19N — CID 104813751

IUPAC(2-pent-3-ynylcyclopentyl)methanamine
SMILESCC#CCCC1CCCC1CN
InChIInChI=1S/C11H19N/c1-2-3-4-6-10-7-5-8-11(10)9-12/h10-11H,4-9,12H2,1H3
InChIKeyLFLVHWPKZIMIPU-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.16
Rot. Bonds3

About (2-pent-3-ynylcyclopentyl)methanamine

(2-pent-3-ynylcyclopentyl)methanamine (PubChem CID 104813751) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (2-pent-3-ynylcyclopentyl)methanamine.

Molecular Properties

Compound Name(2-pent-3-ynylcyclopentyl)methanamine
PubChem CID104813751
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(2-pent-3-ynylcyclopentyl)methanamine
SMILESCC#CCCC1CCCC1CN
InChIInChI=1S/C11H19N/c1-2-3-4-6-10-7-5-8-11(10)9-12/h10-11H,4-9,12H2,1H3
InChIKeyLFLVHWPKZIMIPU-UHFFFAOYSA-N
XLogP2.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

2-pent-3-ynylcyclohexan-1-ol
CID 104810024
2-(aminomethyl)-N-methyl-N-pent-3-ynylcyclohexan-1-amine
CID 104809042
[(1S,2S)-2-propylcyclopentyl]methanamine
CID 124512847
(2-but-3-ynylcycloheptyl)methanamine
CID 81010939
3-pent-3-ynyloxan-4-ol
CID 106471270
3-pent-3-ynylcycloheptan-1-amine
CID 104811921
[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine
CID 84716624
1-[2-(aminomethyl)cyclohexyl]pent-3-yn-1-one
CID 116584514
[(1S,2R)-2-ethylcyclohexyl]methanamine
CID 124508805
1-cyclobutylhex-4-yn-1-amine
CID 104805819
2-(aminomethyl)-N-methyl-N-propan-2-ylcyclopentan-1-amine
CID 43293401
(2-tert-butylcyclopentyl)methanamine
CID 81010669

Frequently Asked Questions

What is the IUPAC name of (2-pent-3-ynylcyclopentyl)methanamine?
The IUPAC name of (2-pent-3-ynylcyclopentyl)methanamine (CID 104813751) is (2-pent-3-ynylcyclopentyl)methanamine.
What is the SMILES notation for (2-pent-3-ynylcyclopentyl)methanamine?
The canonical SMILES for (2-pent-3-ynylcyclopentyl)methanamine is CC#CCCC1CCCC1CN.
What is the InChIKey of (2-pent-3-ynylcyclopentyl)methanamine?
The InChIKey is LFLVHWPKZIMIPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-2-3-4-6-10-7-5-8-11(10)9-12/h10-11H,4-9,12H2,1H3.
What are the key properties of (2-pent-3-ynylcyclopentyl)methanamine?
(2-pent-3-ynylcyclopentyl)methanamine has a molecular weight of 165.28 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pent-3-ynylcyclopentyl)methanamine is sourced from PubChem (CID 104813751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).