2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide

C15H30N2O2 — CID 115359404

IUPAC2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NCC1(CO)CCCC1
InChIInChI=1S/C15H30N2O2/c1-3-4-7-10-16-14(19)13(2)17-11-15(12-18)8-5-6-9-15/h13,17-18H,3-12H2,1-2H3,(H,16,19)
InChIKeyFUWSBTSBLZEZKS-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.82
Rot. Bonds9

About 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide

2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide (PubChem CID 115359404) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide.

Molecular Properties

Compound Name2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide
PubChem CID115359404
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NCC1(CO)CCCC1
InChIInChI=1S/C15H30N2O2/c1-3-4-7-10-16-14(19)13(2)17-11-15(12-18)8-5-6-9-15/h13,17-18H,3-12H2,1-2H3,(H,16,19)
InChIKeyFUWSBTSBLZEZKS-UHFFFAOYSA-N
XLogP1.82
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide
CID 65109318
2-[[1-(hydroxymethyl)cyclohexyl]methylamino]-N-(3-methoxypropyl)propanamide
CID 103966438
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentan-3-ylpropanamide
CID 115359406
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-(2-methylpropyl)propanamide
CID 113293813
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentan-2-ylpropanamide
CID 115359436
2-[(1-ethylcyclobutyl)methylamino]-N-propylpropanamide
CID 103771878
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-N-pentan-3-ylpropanamide
CID 113313239
[1-[(hexylamino)methyl]cyclopentyl]methanol
CID 115358683
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N,N-dimethylpropanamide
CID 115359532
2-acetamido-N-[[1-(hydroxymethyl)cyclohexyl]methyl]propanamide
CID 112699726
2-(2-cyclopropylpropylamino)-N-pentylpropanamide
CID 115591539
N-(furan-2-ylmethyl)-2-[[1-(hydroxymethyl)cyclohexyl]methylamino]propanamide
CID 103966369

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide?
The IUPAC name of 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide (CID 115359404) is 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide.
What is the SMILES notation for 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide?
The canonical SMILES for 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide is CCCCCNC(=O)C(C)NCC1(CO)CCCC1.
What is the InChIKey of 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide?
The InChIKey is FUWSBTSBLZEZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-3-4-7-10-16-14(19)13(2)17-11-15(12-18)8-5-6-9-15/h13,17-18H,3-12H2,1-2H3,(H,16,19).
What are the key properties of 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide?
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide has a molecular weight of 270.42 g/mol, XLogP of 1.82, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide is sourced from PubChem (CID 115359404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).