(2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol

C11H23NO — CID 103922421

IUPAC(2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol
SMILESCC[C@H](CO)NC(C(C)C)C1CC1
InChIInChI=1S/C11H23NO/c1-4-10(7-13)12-11(8(2)3)9-5-6-9/h8-13H,4-7H2,1-3H3/t10-,11?/m1/s1
InChIKeyNQKLAIAQGOFUDZ-NFJWQWPMSA-N
MW185.31 g/mol
LogP1.78
Rot. Bonds6

About (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol

(2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol (PubChem CID 103922421) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol
PubChem CID103922421
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name(2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol
SMILESCC[C@H](CO)NC(C(C)C)C1CC1
InChIInChI=1S/C11H23NO/c1-4-10(7-13)12-11(8(2)3)9-5-6-9/h8-13H,4-7H2,1-3H3/t10-,11?/m1/s1
InChIKeyNQKLAIAQGOFUDZ-NFJWQWPMSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1-cyclopropyl-2-methylpropyl)amino]propane-1,3-diol
CID 115724193
(2R)-2-(1-cyclopentylethylamino)butan-1-ol
CID 103922643
2-(1-cyclopropylpropan-2-ylamino)butan-1-ol
CID 115705322
(1R)-1-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine
CID 166781304
(2S)-2-[(1-cyclopropyl-2-methoxyethyl)amino]butan-1-ol
CID 104981008
(2R)-2-[[(3R)-2-methylpentan-3-yl]amino]butan-1-ol
CID 93285453
(2S)-2-(1-hydroxypropan-2-ylamino)butan-1-ol
CID 55300150
(2R)-2-[(2-methyl-1-phenylpropyl)amino]butan-1-ol
CID 103922515
(2S)-2-[[(2S,3R)-3-methylpentan-2-yl]amino]butan-1-ol
CID 28724744
(2R)-2-(4-methylpentan-2-ylamino)butan-1-ol
CID 103922364
(2S)-2-[[(2R)-4-methylpentan-2-yl]amino]butan-1-ol
CID 28723565
N-[(2S)-1-hydroxybutan-2-yl]cyclopropanesulfonamide
CID 104982018

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol?
The IUPAC name of (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol (CID 103922421) is (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol.
What is the SMILES notation for (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol?
The canonical SMILES for (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol is CC[C@H](CO)NC(C(C)C)C1CC1.
What is the InChIKey of (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol?
The InChIKey is NQKLAIAQGOFUDZ-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-10(7-13)12-11(8(2)3)9-5-6-9/h8-13H,4-7H2,1-3H3/t10-,11?/m1/s1.
What are the key properties of (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol?
(2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1-cyclopropyl-2-methylpropyl)amino]butan-1-ol is sourced from PubChem (CID 103922421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).