N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide

C14H28N2O — CID 114754126

IUPACN-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide
SMILESCCCCCCC(=O)NCC1(CN)CCCC1
InChIInChI=1S/C14H28N2O/c1-2-3-4-5-8-13(17)16-12-14(11-15)9-6-7-10-14/h2-12,15H2,1H3,(H,16,17)
InChIKeyUJELWBLTIDQNNI-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.59
Rot. Bonds8

About N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide

N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide (PubChem CID 114754126) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide
PubChem CID114754126
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide
SMILESCCCCCCC(=O)NCC1(CN)CCCC1
InChIInChI=1S/C14H28N2O/c1-2-3-4-5-8-13(17)16-12-14(11-15)9-6-7-10-14/h2-12,15H2,1H3,(H,16,17)
InChIKeyUJELWBLTIDQNNI-UHFFFAOYSA-N
XLogP2.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(chloromethyl)cyclopentyl]methyl]octanamide
CID 115363870
N-[[1-(chloromethyl)cyclohexyl]methyl]decanamide
CID 103969577
2-[1-[(heptanoylamino)methyl]cyclobutyl]acetic acid
CID 81165521
N-[[1-(bromomethyl)cyclohexyl]methyl]hexanamide
CID 103969906
N-[[1-(bromomethyl)cyclopropyl]methyl]dodecanamide
CID 115456236
N-[(1-aminocyclobutyl)methyl]decanamide
CID 113412065
N-[(1-hydroxycyclobutyl)methyl]nonanamide
CID 115668880
N-[(1-ethylcyclohexyl)methyl]acetamide;N-[(1-ethylcyclohexyl)methyl]dodecanamide;N-[(1-ethylcyclohexyl)methyl]heptanamide;N-[(1-ethylcyclohexyl)methyl]hexanamide;N-[(1-ethylcyclohexyl)methyl]undecanamide;N-[[1-(2-oxopropyl)cyclohexyl]methyl]decanamide;N-[[1-(2-oxopropyl)cyclohexyl]methyl]nonanamide;N-[[1-(2-oxopropyl)cyclohexyl]methyl]octanamide
CID 161460753
6-[(1-ethylcyclopentyl)methylamino]-6-oxohexanoic acid
CID 114124800
4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride
CID 119339921
N-[[1-(hydroxymethyl)cyclohexyl]methyl]butanamide
CID 110292524
N-[[1-(aminomethyl)cyclohexyl]methyl]-2-propoxyacetamide
CID 107941625

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide?
The IUPAC name of N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide (CID 114754126) is N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide?
The canonical SMILES for N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide is CCCCCCC(=O)NCC1(CN)CCCC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide?
The InChIKey is UJELWBLTIDQNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-3-4-5-8-13(17)16-12-14(11-15)9-6-7-10-14/h2-12,15H2,1H3,(H,16,17).
What are the key properties of N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide?
N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide has a molecular weight of 240.39 g/mol, XLogP of 2.59, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopentyl]methyl]heptanamide is sourced from PubChem (CID 114754126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).