(3R)-3-(cyclopentylmethylamino)butan-1-ol

C10H21NO — CID 103923917

IUPAC(3R)-3-(cyclopentylmethylamino)butan-1-ol
SMILESC[C@H](CCO)NCC1CCCC1
InChIInChI=1S/C10H21NO/c1-9(6-7-12)11-8-10-4-2-3-5-10/h9-12H,2-8H2,1H3/t9-/m1/s1
InChIKeyPNJTWMBEHLAHEG-SECBINFHSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds5

About (3R)-3-(cyclopentylmethylamino)butan-1-ol

(3R)-3-(cyclopentylmethylamino)butan-1-ol (PubChem CID 103923917) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (3R)-3-(cyclopentylmethylamino)butan-1-ol.

Molecular Properties

Compound Name(3R)-3-(cyclopentylmethylamino)butan-1-ol
PubChem CID103923917
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(3R)-3-(cyclopentylmethylamino)butan-1-ol
SMILESC[C@H](CCO)NCC1CCCC1
InChIInChI=1S/C10H21NO/c1-9(6-7-12)11-8-10-4-2-3-5-10/h9-12H,2-8H2,1H3/t9-/m1/s1
InChIKeyPNJTWMBEHLAHEG-SECBINFHSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
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

(3R)-3-(2-cycloheptylethylamino)butan-1-ol
CID 28957329
3-(cycloheptylmethylamino)pentan-1-ol
CID 115685732
6-(cyclopentylmethylamino)-2-methylheptanoic acid
CID 65289181
2-(cyclopropylmethylamino)propan-1-ol
CID 43560365
N-(cyclohexylmethyl)pent-4-yn-2-amine
CID 115757028
3-(cyclopentylmethylamino)butanoic acid
CID 43536958
(3R)-3-(4-cyclohexylbutan-2-ylamino)butan-1-ol
CID 103871740
3-(oxolan-2-ylmethylamino)butan-1-ol
CID 83177846
4-(4-cyclopentylbutan-2-ylamino)-3-methylbutan-1-ol
CID 115725107
2-(cyclopentylmethylamino)propanoic acid
CID 61344306
3-(2-cyclopropylethylamino)butan-1-ol
CID 83178015
methyl 3-(cyclopentylmethylamino)butanoate
CID 43536965

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(cyclopentylmethylamino)butan-1-ol?
The IUPAC name of (3R)-3-(cyclopentylmethylamino)butan-1-ol (CID 103923917) is (3R)-3-(cyclopentylmethylamino)butan-1-ol.
What is the SMILES notation for (3R)-3-(cyclopentylmethylamino)butan-1-ol?
The canonical SMILES for (3R)-3-(cyclopentylmethylamino)butan-1-ol is C[C@H](CCO)NCC1CCCC1.
What is the InChIKey of (3R)-3-(cyclopentylmethylamino)butan-1-ol?
The InChIKey is PNJTWMBEHLAHEG-SECBINFHSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(6-7-12)11-8-10-4-2-3-5-10/h9-12H,2-8H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-3-(cyclopentylmethylamino)butan-1-ol?
(3R)-3-(cyclopentylmethylamino)butan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(cyclopentylmethylamino)butan-1-ol is sourced from PubChem (CID 103923917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).