(2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol

C11H21NO — CID 103935199

IUPAC(2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol
SMILESC[C@@H](O)CN(CC1CC1)CC1CC1
InChIInChI=1S/C11H21NO/c1-9(13)6-12(7-10-2-3-10)8-11-4-5-11/h9-11,13H,2-8H2,1H3/t9-/m1/s1
InChIKeyXTJJWPPQEGYYCR-SECBINFHSA-N
MW183.30 g/mol
LogP1.49
Rot. Bonds6

About (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol

(2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol (PubChem CID 103935199) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol
PubChem CID103935199
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC Name(2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol
SMILESC[C@@H](O)CN(CC1CC1)CC1CC1
InChIInChI=1S/C11H21NO/c1-9(13)6-12(7-10-2-3-10)8-11-4-5-11/h9-11,13H,2-8H2,1H3/t9-/m1/s1
InChIKeyXTJJWPPQEGYYCR-SECBINFHSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-[cyclopropylmethyl(propyl)amino]propan-2-ol
CID 103935017
1-[cyclobutylmethyl(ethyl)amino]propan-2-ol
CID 103714006
3-[bis(cyclopropylmethyl)amino]-2-(propan-2-ylamino)propan-1-ol
CID 64790238
N-[[4-(aminomethyl)cyclohexyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 79527297
(2R)-1-[piperidin-4-ylmethyl(propan-2-yl)amino]propan-2-ol
CID 106933609
4-[[bis(2-methylpropyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 21470529
1-[[3-[[ethoxymethyl(oxiran-2-ylmethyl)amino]methyl]cyclohexyl]methyl-(oxiran-2-ylmethyl)amino]propan-2-ol
CID 146179155
1-[4-(2-hydroxypropyl)cyclohexyl]propan-2-ol
CID 19387430
N-(cyclopropylmethyl)-3-methyl-N-propylbutan-1-amine
CID 21355618
N-(cyclopropylmethyl)-2,2-dimethyl-N-(2-methylpropyl)propan-1-amine
CID 126597968
2-chloro-N-(cyclopropylmethyl)-N-methylpropan-1-amine
CID 63387305
(2S)-1-N-(cyclopropylmethyl)-1-N-methylpropane-1,2-diamine
CID 93424361

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol?
The IUPAC name of (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol (CID 103935199) is (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol.
What is the SMILES notation for (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol?
The canonical SMILES for (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol is C[C@@H](O)CN(CC1CC1)CC1CC1.
What is the InChIKey of (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol?
The InChIKey is XTJJWPPQEGYYCR-SECBINFHSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(13)6-12(7-10-2-3-10)8-11-4-5-11/h9-11,13H,2-8H2,1H3/t9-/m1/s1.
What are the key properties of (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol?
(2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol has a molecular weight of 183.30 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[bis(cyclopropylmethyl)amino]propan-2-ol is sourced from PubChem (CID 103935199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).