2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide

C14H28N2O2 — CID 65109318

IUPAC2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NCC1(O)CCCC1
InChIInChI=1S/C14H28N2O2/c1-3-4-7-10-15-13(17)12(2)16-11-14(18)8-5-6-9-14/h12,16,18H,3-11H2,1-2H3,(H,15,17)
InChIKeyCGSZIOTTWDSOQB-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.58
Rot. Bonds8

About 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide

2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide (PubChem CID 65109318) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide.

Molecular Properties

Compound Name2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide
PubChem CID65109318
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NCC1(O)CCCC1
InChIInChI=1S/C14H28N2O2/c1-3-4-7-10-15-13(17)12(2)16-11-14(18)8-5-6-9-14/h12,16,18H,3-11H2,1-2H3,(H,15,17)
InChIKeyCGSZIOTTWDSOQB-UHFFFAOYSA-N
XLogP1.58
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.58
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

N-butyl-2-[(4-hydroxyoxan-4-yl)methylamino]propanamide
CID 81131394
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide
CID 115359404
2-[(1-hydroxycyclopentyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 65109266
2-[(1-hydroxycyclopentyl)methylamino]-N-pentan-3-ylpropanamide
CID 65111296
2-[(1-hydroxycycloheptyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 65123309
2-[(1-hydroxycyclopentyl)methylamino]-N-pentan-2-ylpropanamide
CID 65109113
2-[(1-hydroxycyclopentyl)methylamino]propanoic acid
CID 65108936
1-[(nonan-2-ylamino)methyl]cyclopentan-1-ol
CID 65105272
2-[(3-amino-3-oxopropyl)amino]-N-pentylpropanamide
CID 43553504
1-[(hexan-2-ylamino)methyl]cyclopentan-1-ol
CID 65105584
1-[(dodecylamino)methyl]cyclopentan-1-ol
CID 65108837
2-[(1-ethylcyclobutyl)methylamino]-N-propylpropanamide
CID 103771878

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide?
The IUPAC name of 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide (CID 65109318) is 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide.
What is the SMILES notation for 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide?
The canonical SMILES for 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide is CCCCCNC(=O)C(C)NCC1(O)CCCC1.
What is the InChIKey of 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide?
The InChIKey is CGSZIOTTWDSOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-4-7-10-15-13(17)12(2)16-11-14(18)8-5-6-9-14/h12,16,18H,3-11H2,1-2H3,(H,15,17).
What are the key properties of 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide?
2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 1.58, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide is sourced from PubChem (CID 65109318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).