3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol

C11H23NO — CID 103271506

IUPAC3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol
SMILESCCC(CC)NCC1CCC(O)C1
InChIInChI=1S/C11H23NO/c1-3-10(4-2)12-8-9-5-6-11(13)7-9/h9-13H,3-8H2,1-2H3
InChIKeyMDAMMSFZSJWOPX-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.93
Rot. Bonds5

About 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol

3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol (PubChem CID 103271506) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol
PubChem CID103271506
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol
SMILESCCC(CC)NCC1CCC(O)C1
InChIInChI=1S/C11H23NO/c1-3-10(4-2)12-8-9-5-6-11(13)7-9/h9-13H,3-8H2,1-2H3
InChIKeyMDAMMSFZSJWOPX-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(pentan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271338
2-[(3-hydroxycyclopentyl)methylamino]butanamide
CID 106129414
3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271439
3-[(but-3-yn-2-ylamino)methyl]cyclopentan-1-ol
CID 106129449
3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271450
3-[(1,1-dimethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 106121090
2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide
CID 103279737
2-[(3-hydroxycyclohexyl)methylamino]-N-pentan-3-ylpropanamide
CID 106131934
3-[[1-(4-ethylphenyl)propylamino]methyl]cyclopentan-1-ol
CID 103271372
3-[(2-methylpropylamino)methyl]cyclopentan-1-ol
CID 103270977
3-[[(4-methoxy-4-methylpentan-2-yl)amino]methyl]cyclopentan-1-ol
CID 103271409
3-[[1-(4-propan-2-ylphenyl)ethylamino]methyl]cyclopentan-1-ol
CID 103271482

Frequently Asked Questions

What is the IUPAC name of 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol (CID 103271506) is 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol is CCC(CC)NCC1CCC(O)C1.
What is the InChIKey of 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is MDAMMSFZSJWOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-10(4-2)12-8-9-5-6-11(13)7-9/h9-13H,3-8H2,1-2H3.
What are the key properties of 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol?
3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 103271506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).