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

C9H19NO — CID 103871785

IUPAC(3R)-3-(1-cyclopropylethylamino)butan-1-ol
SMILESCC(N[C@H](C)CCO)C1CC1
InChIInChI=1S/C9H19NO/c1-7(5-6-11)10-8(2)9-3-4-9/h7-11H,3-6H2,1-2H3/t7-,8?/m1/s1
InChIKeyNXTSRNSIKVZNKP-GVHYBUMESA-N
MW157.26 g/mol
LogP1.15
Rot. Bonds5

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

(3R)-3-(1-cyclopropylethylamino)butan-1-ol (PubChem CID 103871785) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (3R)-3-(1-cyclopropylethylamino)butan-1-ol.

Molecular Properties

Compound Name(3R)-3-(1-cyclopropylethylamino)butan-1-ol
PubChem CID103871785
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(3R)-3-(1-cyclopropylethylamino)butan-1-ol
SMILESCC(N[C@H](C)CCO)C1CC1
InChIInChI=1S/C9H19NO/c1-7(5-6-11)10-8(2)9-3-4-9/h7-11H,3-6H2,1-2H3/t7-,8?/m1/s1
InChIKeyNXTSRNSIKVZNKP-GVHYBUMESA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-3-(1-cyclopropylethylamino)propan-1-ol
CID 115677287
(4R)-4-[[(1R)-1-cyclohexylethyl]amino]pentan-1-ol
CID 97051641
(3R)-3-(1-cyclopropylpropylamino)butan-1-ol
CID 103871687
N-(1-cyclopropylethyl)hexan-2-amine
CID 43776552
3-(1-cyclopropylethylamino)-4,4-dimethylpentan-1-ol
CID 104925922
N-(1-cyclopropylethyl)butan-2-amine
CID 43190238
(2R)-2-(1-cyclopentylethylamino)propan-1-ol
CID 114987079
3-(1-cyclobutylpropan-2-ylamino)butan-1-ol
CID 115722186
3-(1-cyclopentylethylamino)-4-methylpentan-1-ol
CID 115724580
4-(1-cyclopropylethylamino)-3-methylbutan-1-ol
CID 66089907
3-(1-cyclohexylethylamino)-4,4-dimethylpentan-1-ol
CID 113438636
(3R)-3-(4-cyclohexylbutan-2-ylamino)butan-1-ol
CID 103871740

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(1-cyclopropylethylamino)butan-1-ol?
The IUPAC name of (3R)-3-(1-cyclopropylethylamino)butan-1-ol (CID 103871785) is (3R)-3-(1-cyclopropylethylamino)butan-1-ol.
What is the SMILES notation for (3R)-3-(1-cyclopropylethylamino)butan-1-ol?
The canonical SMILES for (3R)-3-(1-cyclopropylethylamino)butan-1-ol is CC(N[C@H](C)CCO)C1CC1.
What is the InChIKey of (3R)-3-(1-cyclopropylethylamino)butan-1-ol?
The InChIKey is NXTSRNSIKVZNKP-GVHYBUMESA-N. The full InChI is InChI=1S/C9H19NO/c1-7(5-6-11)10-8(2)9-3-4-9/h7-11H,3-6H2,1-2H3/t7-,8?/m1/s1.
What are the key properties of (3R)-3-(1-cyclopropylethylamino)butan-1-ol?
(3R)-3-(1-cyclopropylethylamino)butan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(1-cyclopropylethylamino)butan-1-ol is sourced from PubChem (CID 103871785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).