5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol

C15H32N2O — CID 64797279

IUPAC5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
SMILESCC(C)NC(C)(CO)CCCN(C)C(C)C1CC1
InChIInChI=1S/C15H32N2O/c1-12(2)16-15(4,11-18)9-6-10-17(5)13(3)14-7-8-14/h12-14,16,18H,6-11H2,1-5H3
InChIKeyRDFOFRKUZAQTJE-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds9

About 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol

5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol (PubChem CID 64797279) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol.

Molecular Properties

Compound Name5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
PubChem CID64797279
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
SMILESCC(C)NC(C)(CO)CCCN(C)C(C)C1CC1
InChIInChI=1S/C15H32N2O/c1-12(2)16-15(4,11-18)9-6-10-17(5)13(3)14-7-8-14/h12-14,16,18H,6-11H2,1-5H3
InChIKeyRDFOFRKUZAQTJE-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[cyclopropyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)hexan-1-ol
CID 64798501
5-[cyclopropyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64795940
2-methyl-5-[methyl(oxan-4-yl)amino]-2-(propan-2-ylamino)pentan-1-ol
CID 64798346
6-[1-methoxypropan-2-yl(methyl)amino]-2-methyl-2-(propan-2-ylamino)hexan-1-ol
CID 64826309
2-(cyclopropylamino)-3-[1-cyclopropylethyl(methyl)amino]-2-methylpropan-1-ol
CID 64797072
4-[cyclobutylmethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64787804
5-[4-(dimethylamino)piperidin-1-yl]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64795994
4-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64825256
2-methyl-4-[methyl(pentan-3-yl)amino]-2-(propan-2-ylamino)butan-1-ol
CID 64795544
5-cyclobutyloxy-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64808655
2-methyl-5-[methyl(2-methylsulfonylethyl)amino]-2-(propan-2-ylamino)pentan-1-ol
CID 79859172
2-methyl-6-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propan-2-ylamino)hexan-1-ol
CID 64787613

Frequently Asked Questions

What is the IUPAC name of 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
The IUPAC name of 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol (CID 64797279) is 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol.
What is the SMILES notation for 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
The canonical SMILES for 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol is CC(C)NC(C)(CO)CCCN(C)C(C)C1CC1.
What is the InChIKey of 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
The InChIKey is RDFOFRKUZAQTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)16-15(4,11-18)9-6-10-17(5)13(3)14-7-8-14/h12-14,16,18H,6-11H2,1-5H3.
What are the key properties of 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-cyclopropylethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol is sourced from PubChem (CID 64797279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).