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

C10H21NO — CID 103871687

IUPAC(3R)-3-(1-cyclopropylpropylamino)butan-1-ol
SMILESCCC(N[C@H](C)CCO)C1CC1
InChIInChI=1S/C10H21NO/c1-3-10(9-4-5-9)11-8(2)6-7-12/h8-12H,3-7H2,1-2H3/t8-,10?/m1/s1
InChIKeyCLBFUFQKTNYJMJ-HNHGDDPOSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds6

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

(3R)-3-(1-cyclopropylpropylamino)butan-1-ol (PubChem CID 103871687) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (3R)-3-(1-cyclopropylpropylamino)butan-1-ol.

Molecular Properties

Compound Name(3R)-3-(1-cyclopropylpropylamino)butan-1-ol
PubChem CID103871687
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(3R)-3-(1-cyclopropylpropylamino)butan-1-ol
SMILESCCC(N[C@H](C)CCO)C1CC1
InChIInChI=1S/C10H21NO/c1-3-10(9-4-5-9)11-8(2)6-7-12/h8-12H,3-7H2,1-2H3/t8-,10?/m1/s1
InChIKeyCLBFUFQKTNYJMJ-HNHGDDPOSA-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

N-(1-cyclopropylpropyl)-4-methylsulfanylbutan-2-amine
CID 115722054
(3R)-3-(1-cyclopropylethylamino)butan-1-ol
CID 103871785
2-(1-cyclohexylpropylamino)propan-1-ol
CID 115724810
3-cyclopropyl-3-(3-methylpentan-2-ylamino)propan-1-ol
CID 115891712
3-cyclopropyl-3-(1-cyclopropylethylamino)propan-1-ol
CID 115677287
(3S)-3-(butan-2-ylamino)butan-1-ol
CID 131065371
3-(1-cyclopropylpropylamino)-N-propan-2-ylbutanamide
CID 115724442
3-[(1-cyclopropylpropylamino)methyl]-5-methylhexan-1-ol
CID 115726083
3-(1-cyclopropylbutylamino)pentan-1-ol
CID 115770052
N-(1-cyclopropylpropyl)-2-methylpentan-3-amine
CID 64917590
3-(1-cyclobutylpropan-2-ylamino)butan-1-ol
CID 115722186
N-(1-cyclopropylpropyl)-4-methoxy-4-methylpentan-2-amine
CID 115724125

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(1-cyclopropylpropylamino)butan-1-ol?
The IUPAC name of (3R)-3-(1-cyclopropylpropylamino)butan-1-ol (CID 103871687) is (3R)-3-(1-cyclopropylpropylamino)butan-1-ol.
What is the SMILES notation for (3R)-3-(1-cyclopropylpropylamino)butan-1-ol?
The canonical SMILES for (3R)-3-(1-cyclopropylpropylamino)butan-1-ol is CCC(N[C@H](C)CCO)C1CC1.
What is the InChIKey of (3R)-3-(1-cyclopropylpropylamino)butan-1-ol?
The InChIKey is CLBFUFQKTNYJMJ-HNHGDDPOSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-10(9-4-5-9)11-8(2)6-7-12/h8-12H,3-7H2,1-2H3/t8-,10?/m1/s1.
What are the key properties of (3R)-3-(1-cyclopropylpropylamino)butan-1-ol?
(3R)-3-(1-cyclopropylpropylamino)butan-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 (3R)-3-(1-cyclopropylpropylamino)butan-1-ol is sourced from PubChem (CID 103871687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).