2-[(cyclobutylamino)methyl]pentan-1-ol

C10H21NO — CID 117241776

IUPAC2-[(cyclobutylamino)methyl]pentan-1-ol
SMILESCCCC(CO)CNC1CCC1
InChIInChI=1S/C10H21NO/c1-2-4-9(8-12)7-11-10-5-3-6-10/h9-12H,2-8H2,1H3
InChIKeyPKCOOFVOOWQGGG-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds6

About 2-[(cyclobutylamino)methyl]pentan-1-ol

2-[(cyclobutylamino)methyl]pentan-1-ol (PubChem CID 117241776) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-[(cyclobutylamino)methyl]pentan-1-ol.

Molecular Properties

Compound Name2-[(cyclobutylamino)methyl]pentan-1-ol
PubChem CID117241776
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-[(cyclobutylamino)methyl]pentan-1-ol
SMILESCCCC(CO)CNC1CCC1
InChIInChI=1S/C10H21NO/c1-2-4-9(8-12)7-11-10-5-3-6-10/h9-12H,2-8H2,1H3
InChIKeyPKCOOFVOOWQGGG-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(1-methylpiperidin-4-yl)amino]methyl]pentan-1-ol
CID 142846746
2-[(cyclopentylamino)methyl]-4-methoxybutan-1-ol
CID 117236803
3-[[(3-methylcyclohexyl)amino]methyl]hexan-1-ol
CID 115660374
3-[(thian-4-ylamino)methyl]hexan-1-ol
CID 111470638
3-[(thian-3-ylamino)methyl]hexan-1-ol
CID 115882200
N-[2-(2-methoxyethyl)pentyl]cyclopropanamine
CID 62528132
1-[4-[2-(2-hydroxyethyl)pentylamino]piperidin-1-yl]ethanone
CID 103707935
1-(cyclobutylamino)butan-2-ol
CID 62416322
2-cyclobutyl-3-(cyclobutylamino)propan-1-ol
CID 117245604
trans-(1R,2R)-2-[2-(2-hydroxyethyl)pentylamino]cyclopentan-1-ol
CID 106115022
2-methyl-3-[(4-methylcycloheptyl)amino]propan-1-ol
CID 65079742
2-[(cyclopentylamino)methyl]pentanoic acid
CID 82933542

Frequently Asked Questions

What is the IUPAC name of 2-[(cyclobutylamino)methyl]pentan-1-ol?
The IUPAC name of 2-[(cyclobutylamino)methyl]pentan-1-ol (CID 117241776) is 2-[(cyclobutylamino)methyl]pentan-1-ol.
What is the SMILES notation for 2-[(cyclobutylamino)methyl]pentan-1-ol?
The canonical SMILES for 2-[(cyclobutylamino)methyl]pentan-1-ol is CCCC(CO)CNC1CCC1.
What is the InChIKey of 2-[(cyclobutylamino)methyl]pentan-1-ol?
The InChIKey is PKCOOFVOOWQGGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-4-9(8-12)7-11-10-5-3-6-10/h9-12H,2-8H2,1H3.
What are the key properties of 2-[(cyclobutylamino)methyl]pentan-1-ol?
2-[(cyclobutylamino)methyl]pentan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(cyclobutylamino)methyl]pentan-1-ol is sourced from PubChem (CID 117241776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).