1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine

C19H41NO — CID 145336371

IUPAC1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine
SMILESCC.CC(C)C(O)C1CCCC1.CC(C)NC1CCCC1
InChIInChI=1S/C9H18O.C8H17N.C2H6/c1-7(2)9(10)8-5-3-4-6-8;1-7(2)9-8-5-3-4-6-8;1-2/h7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;1-2H3
InChIKeyRYRMJXYTIDMJTF-UHFFFAOYSA-N
MW299.54 g/mol
LogP5.15
Rot. Bonds4

About 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine

1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine (PubChem CID 145336371) has the molecular formula C19H41NO and a molecular weight of 299.54 g/mol. Its IUPAC name is 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine
PubChem CID145336371
Molecular FormulaC19H41NO
Molecular Weight299.54 g/mol
Exact Mass299.32
IUPAC Name1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine
SMILESCC.CC(C)C(O)C1CCCC1.CC(C)NC1CCCC1
InChIInChI=1S/C9H18O.C8H17N.C2H6/c1-7(2)9(10)8-5-3-4-6-8;1-7(2)9-8-5-3-4-6-8;1-2/h7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;1-2H3
InChIKeyRYRMJXYTIDMJTF-UHFFFAOYSA-N
XLogP5.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.54
LogP ≤ 55.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-propan-2-ylcycloheptanamine
CID 42562651
1-(cyclopentylamino)ethanol
CID 18784157
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
1-cycloheptylpropane-1,2-diol
CID 103452573
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-(3-methylbutan-2-yl)cycloheptanamine
CID 43181172
[(2R)-3-methylbutan-2-yl]cyclopentane
CID 59954478
3-(propan-2-ylamino)cycloheptan-1-ol
CID 160609920
3-cyclododecylbutan-2-ol
CID 10444334
3-cyclobutylbutan-2-ol
CID 54399039
ethane;1-N-methyl-4-N-propan-2-ylcyclohexane-1,4-diamine;molecular hydrogen
CID 177228203
2-chloro-1-cyclopentylpropan-1-ol
CID 116863753

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine?
The IUPAC name of 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine (CID 145336371) is 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine.
What is the SMILES notation for 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine?
The canonical SMILES for 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine is CC.CC(C)C(O)C1CCCC1.CC(C)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine?
The InChIKey is RYRMJXYTIDMJTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O.C8H17N.C2H6/c1-7(2)9(10)8-5-3-4-6-8;1-7(2)9-8-5-3-4-6-8;1-2/h7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;1-2H3.
What are the key properties of 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine?
1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine has a molecular weight of 299.54 g/mol, XLogP of 5.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-methylpropan-1-ol;ethane;N-propan-2-ylcyclopentanamine is sourced from PubChem (CID 145336371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).