2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol

C14H31N3O — CID 102998380

IUPAC2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol
SMILESCCN(CCCN(C)C)CC(C)(CO)NC1CC1
InChIInChI=1S/C14H31N3O/c1-5-17(10-6-9-16(3)4)11-14(2,12-18)15-13-7-8-13/h13,15,18H,5-12H2,1-4H3
InChIKeyHOPWQEIKDNMFQB-UHFFFAOYSA-N
MW257.42 g/mol
LogP0.76
Rot. Bonds10

About 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol

2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol (PubChem CID 102998380) has the molecular formula C14H31N3O and a molecular weight of 257.42 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol
PubChem CID102998380
Molecular FormulaC14H31N3O
Molecular Weight257.42 g/mol
Exact Mass257.25
IUPAC Name2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol
SMILESCCN(CCCN(C)C)CC(C)(CO)NC1CC1
InChIInChI=1S/C14H31N3O/c1-5-17(10-6-9-16(3)4)11-14(2,12-18)15-13-7-8-13/h13,15,18H,5-12H2,1-4H3
InChIKeyHOPWQEIKDNMFQB-UHFFFAOYSA-N
XLogP0.76
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[bis(2-methylpropyl)amino]-2-(cyclopropylamino)-2-methylpropan-1-ol
CID 64828074
2-(cyclopropylamino)-6-[ethyl(propyl)amino]-2-methylhexan-1-ol
CID 64797663
N-cyclopropyl-N'-[3-(dimethylamino)propyl]-N',2-diethyl-2-methylpropane-1,3-diamine
CID 102997075
2-cyclopropyl-3-[3-(dimethylamino)propyl-ethylamino]-2-(propylamino)propan-1-ol
CID 102998387
2-(cyclopropylamino)-2-methyl-3-[methyl(pentan-3-yl)amino]propan-1-ol
CID 64796626
4-[cyclobutylmethyl(ethyl)amino]-2-(cyclopropylamino)-2-methylbutan-1-ol
CID 107402539
3-(N-butylanilino)-2-(cyclopropylamino)-2-methylpropan-1-ol
CID 64810630
2-(cyclopropylamino)-3-[1-cyclopropylethyl(methyl)amino]-2-methylpropan-1-ol
CID 64797072
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol
CID 64796814
5-[bis(2-methoxyethyl)amino]-2-(cyclopropylamino)-2-methylpentan-1-ol
CID 64827377
2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
CID 64828099
2-(cyclopropylamino)-2-methyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentan-1-ol
CID 64826457

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol (CID 102998380) is 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol is CCN(CCCN(C)C)CC(C)(CO)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol?
The InChIKey is HOPWQEIKDNMFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O/c1-5-17(10-6-9-16(3)4)11-14(2,12-18)15-13-7-8-13/h13,15,18H,5-12H2,1-4H3.
What are the key properties of 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol?
2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol has a molecular weight of 257.42 g/mol, XLogP of 0.76, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropan-1-ol is sourced from PubChem (CID 102998380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).