2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol

C13H26N2O — CID 64825818

IUPAC2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol
SMILESCC(C)N(CC1CC1)CC(N)(CO)C1CC1
InChIInChI=1S/C13H26N2O/c1-10(2)15(7-11-3-4-11)8-13(14,9-16)12-5-6-12/h10-12,16H,3-9,14H2,1-2H3
InChIKeySYWGVULBHVLUAT-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.21
Rot. Bonds7

About 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol

2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol (PubChem CID 64825818) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol
PubChem CID64825818
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol
SMILESCC(C)N(CC1CC1)CC(N)(CO)C1CC1
InChIInChI=1S/C13H26N2O/c1-10(2)15(7-11-3-4-11)8-13(14,9-16)12-5-6-12/h10-12,16H,3-9,14H2,1-2H3
InChIKeySYWGVULBHVLUAT-UHFFFAOYSA-N
XLogP1.21
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-cyclopropyl-3-[2-methylpropyl(propan-2-yl)amino]propan-1-ol
CID 64828209
ethyl 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propanoate
CID 63918207
2-cyclopropyl-2-(cyclopropylamino)-3-[cyclopropylmethyl(propan-2-yl)amino]propanamide
CID 63918014
2-amino-2-cyclopropyl-3-[methyl(2-methylbutyl)amino]propan-1-ol
CID 64795508
2-amino-2-cyclopropyl-3-[ethyl(2-methylbutyl)amino]propan-1-ol
CID 79469873
ethyl 2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]-2-(methylamino)propanoate
CID 63915479
2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propan-1-ol
CID 64796590
3-[cyclopropylmethyl(propan-2-yl)amino]-2,2-dimethylpropanal
CID 62277014
2-amino-2-cyclopropylbutan-1-ol
CID 64919158
2-amino-3-[cyclohexyl(methyl)amino]-2-cyclopropylpropan-1-ol
CID 64796314
3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-amine
CID 66010505
2-amino-2-cyclopropyl-3-[2-methoxyethyl(2-methylpropyl)amino]propan-1-ol
CID 64825518

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol?
The IUPAC name of 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol (CID 64825818) is 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol?
The canonical SMILES for 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol is CC(C)N(CC1CC1)CC(N)(CO)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol?
The InChIKey is SYWGVULBHVLUAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10(2)15(7-11-3-4-11)8-13(14,9-16)12-5-6-12/h10-12,16H,3-9,14H2,1-2H3.
What are the key properties of 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol?
2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-[cyclopropylmethyl(propan-2-yl)amino]propan-1-ol is sourced from PubChem (CID 64825818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).