1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide

C14H24N2O — CID 113311622

IUPAC1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide
SMILESC=CCN(C(=O)C1(CN)CCC1)C1CCCC1
InChIInChI=1S/C14H24N2O/c1-2-10-16(12-6-3-4-7-12)13(17)14(11-15)8-5-9-14/h2,12H,1,3-11,15H2
InChIKeyLYXRWBKCQKCWCH-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.07
Rot. Bonds5

About 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide

1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide (PubChem CID 113311622) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide
PubChem CID113311622
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide
SMILESC=CCN(C(=O)C1(CN)CCC1)C1CCCC1
InChIInChI=1S/C14H24N2O/c1-2-10-16(12-6-3-4-7-12)13(17)14(11-15)8-5-9-14/h2,12H,1,3-11,15H2
InChIKeyLYXRWBKCQKCWCH-UHFFFAOYSA-N
XLogP2.07
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyl-3-methyl-N-prop-2-enylpiperidine-3-carboxamide
CID 63131550
2-(aminomethyl)-N-cyclopentyl-N-prop-2-enylbutanamide
CID 65227499
2-(aminomethyl)-N-cyclopentyl-N-prop-2-enylpentanamide
CID 65227549
2-(aminomethyl)-N-propan-2-yl-N-prop-2-enylpentanamide
CID 65227597
3-amino-N-cyclopentyl-2,2,3-trimethyl-N-prop-2-enylbutanamide
CID 65269426
2-(1-aminocyclobutyl)-N-cyclopentyl-N-prop-2-enylacetamide
CID 79854087
2-(aminomethyl)-N-cyclopentyl-4-methyl-N-prop-2-enylpentanamide
CID 80112380
2-(aminomethyl)-4-methyl-N-propan-2-yl-N-prop-2-enylpentanamide
CID 80112381
1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide
CID 80587539
1-(aminomethyl)-N-cyclopentyl-N-methylcyclobutane-1-carboxamide
CID 80587653
1-(aminomethyl)-N-cyclopentyl-N-ethyl-3-methylcyclobutane-1-carboxamide
CID 80588529
1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide
CID 80588635

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide (CID 113311622) is 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide is C=CCN(C(=O)C1(CN)CCC1)C1CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide?
The InChIKey is LYXRWBKCQKCWCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-2-10-16(12-6-3-4-7-12)13(17)14(11-15)8-5-9-14/h2,12H,1,3-11,15H2.
What are the key properties of 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide?
1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide has a molecular weight of 236.36 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-cyclopentyl-N-prop-2-enylcyclobutane-1-carboxamide is sourced from PubChem (CID 113311622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).