1-(cyclopentylamino)nonan-2-ol

C14H29NO — CID 115002403

IUPAC1-(cyclopentylamino)nonan-2-ol
SMILESCCCCCCCC(O)CNC1CCCC1
InChIInChI=1S/C14H29NO/c1-2-3-4-5-6-11-14(16)12-15-13-9-7-8-10-13/h13-16H,2-12H2,1H3
InChIKeyNZXKYTLDCRECST-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.24
Rot. Bonds9

About 1-(cyclopentylamino)nonan-2-ol

1-(cyclopentylamino)nonan-2-ol (PubChem CID 115002403) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 1-(cyclopentylamino)nonan-2-ol.

Molecular Properties

Compound Name1-(cyclopentylamino)nonan-2-ol
PubChem CID115002403
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name1-(cyclopentylamino)nonan-2-ol
SMILESCCCCCCCC(O)CNC1CCCC1
InChIInChI=1S/C14H29NO/c1-2-3-4-5-6-11-14(16)12-15-13-9-7-8-10-13/h13-16H,2-12H2,1H3
InChIKeyNZXKYTLDCRECST-UHFFFAOYSA-N
XLogP3.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.24
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

1-(cyclooctylamino)-3-hexoxypropan-2-ol
CID 60635229
1-(cyclobutylamino)-3-hexoxypropan-2-ol
CID 62415937
1-(2-butoxyethoxy)-3-(cyclopentylamino)propan-2-ol
CID 60635270
1-(cyclobutylamino)butan-2-ol
CID 62416322
1-(2-butoxyethoxy)-3-(cyclohexylamino)propan-2-ol
CID 60633253
1-(2-hydroxyoctadecylamino)octadecan-2-ol
CID 87182048
1-cycloheptyloctan-2-ol
CID 115783533
N-(2-ethyldodecyl)cyclopropanamine
CID 63521510
1-cyclopentyldecan-3-ol
CID 115783211
1-(methylamino)tetradecan-2-ol
CID 18332301
1-cyclooctylundecan-1-ol
CID 80603651
N-(2-propan-2-yltetradecyl)cyclopropanamine
CID 63520975

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)nonan-2-ol?
The IUPAC name of 1-(cyclopentylamino)nonan-2-ol (CID 115002403) is 1-(cyclopentylamino)nonan-2-ol.
What is the SMILES notation for 1-(cyclopentylamino)nonan-2-ol?
The canonical SMILES for 1-(cyclopentylamino)nonan-2-ol is CCCCCCCC(O)CNC1CCCC1.
What is the InChIKey of 1-(cyclopentylamino)nonan-2-ol?
The InChIKey is NZXKYTLDCRECST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-2-3-4-5-6-11-14(16)12-15-13-9-7-8-10-13/h13-16H,2-12H2,1H3.
What are the key properties of 1-(cyclopentylamino)nonan-2-ol?
1-(cyclopentylamino)nonan-2-ol has a molecular weight of 227.39 g/mol, XLogP of 3.24, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)nonan-2-ol is sourced from PubChem (CID 115002403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).