(1-pent-3-ynylcyclopropyl)methanamine

C9H15N — CID 130515221

IUPAC(1-pent-3-ynylcyclopropyl)methanamine
SMILESCC#CCCC1(CN)CC1
InChIInChI=1S/C9H15N/c1-2-3-4-5-9(8-10)6-7-9/h4-8,10H2,1H3
InChIKeyUEVLXMNKUWQUFG-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.53
Rot. Bonds3

About (1-pent-3-ynylcyclopropyl)methanamine

(1-pent-3-ynylcyclopropyl)methanamine (PubChem CID 130515221) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is (1-pent-3-ynylcyclopropyl)methanamine.

Molecular Properties

Compound Name(1-pent-3-ynylcyclopropyl)methanamine
PubChem CID130515221
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name(1-pent-3-ynylcyclopropyl)methanamine
SMILESCC#CCCC1(CN)CC1
InChIInChI=1S/C9H15N/c1-2-3-4-5-9(8-10)6-7-9/h4-8,10H2,1H3
InChIKeyUEVLXMNKUWQUFG-UHFFFAOYSA-N
XLogP1.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.53
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

(1-pent-3-ynylcyclopentyl)methanamine
CID 126977362
(1-pent-3-ynylcyclobutyl)methanamine
CID 130514795
1-[1-(aminomethyl)cyclopropyl]hex-4-yn-1-one
CID 116601420
4-pent-3-ynylpiperidin-4-ol
CID 104809323
(4,4-dimethyl-1-propylcyclohexyl)methanamine
CID 65389394
8-pent-3-ynylspiro[3.4]octan-8-ol
CID 127011833
3-pent-3-ynylazetidin-3-ol
CID 104809578
2-methyl-2-pent-3-ynylpyrrolidine
CID 104806320
2,2-dimethyl-1-pent-3-ynylcyclopentan-1-ol
CID 104809607
3,3,5,5-tetramethyl-1-pent-3-ynylcyclohexan-1-ol
CID 104809755
[1-(2-propylsulfanylethyl)cyclopropyl]methanamine
CID 84766548
[1-(4-methoxybutyl)cyclopropyl]methanamine
CID 104649416

Frequently Asked Questions

What is the IUPAC name of (1-pent-3-ynylcyclopropyl)methanamine?
The IUPAC name of (1-pent-3-ynylcyclopropyl)methanamine (CID 130515221) is (1-pent-3-ynylcyclopropyl)methanamine.
What is the SMILES notation for (1-pent-3-ynylcyclopropyl)methanamine?
The canonical SMILES for (1-pent-3-ynylcyclopropyl)methanamine is CC#CCCC1(CN)CC1.
What is the InChIKey of (1-pent-3-ynylcyclopropyl)methanamine?
The InChIKey is UEVLXMNKUWQUFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-2-3-4-5-9(8-10)6-7-9/h4-8,10H2,1H3.
What are the key properties of (1-pent-3-ynylcyclopropyl)methanamine?
(1-pent-3-ynylcyclopropyl)methanamine has a molecular weight of 137.23 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pent-3-ynylcyclopropyl)methanamine is sourced from PubChem (CID 130515221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).