N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine

C13H25NO — CID 81386494

IUPACN-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine
SMILESCOCC(N[C@@H](C)C1CCCC1)C1CC1
InChIInChI=1S/C13H25NO/c1-10(11-5-3-4-6-11)14-13(9-15-2)12-7-8-12/h10-14H,3-9H2,1-2H3/t10-,13?/m0/s1
InChIKeyBEGWOLQDKJQHDF-NKUHCKNESA-N
MW211.35 g/mol
LogP2.58
Rot. Bonds6

About N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine

N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine (PubChem CID 81386494) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine.

Molecular Properties

Compound NameN-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine
PubChem CID81386494
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC NameN-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine
SMILESCOCC(N[C@@H](C)C1CCCC1)C1CC1
InChIInChI=1S/C13H25NO/c1-10(11-5-3-4-6-11)14-13(9-15-2)12-7-8-12/h10-14H,3-9H2,1-2H3/t10-,13?/m0/s1
InChIKeyBEGWOLQDKJQHDF-NKUHCKNESA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclohexyl-2-methoxyethyl)propan-2-amine
CID 83686426
N-[(1S)-1-cyclopentylethyl]-1-methoxypropan-2-amine
CID 81385867
1-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)propan-1-amine
CID 115895248
N-[(1S)-1-cyclopentylethyl]-4-methoxybutan-2-amine
CID 81385535
2-(1-cyclopentylethylamino)-3-methoxypropanoic acid
CID 103251911
1-cycloheptyl-N-ethyl-2-methoxyethanamine
CID 79574660
2-N-(1-cyclopropyl-2-methoxyethyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82946294
1-cyclohexyl-N-(1-cyclopentylethyl)ethanamine
CID 62633016
N-(1-cyclopentylethyl)propan-2-amine
CID 59833137
1-cyclopentyl-N-(2-methoxyethyl)ethanamine
CID 62633494
1-cyclopentyl-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105080973
1-methoxypropan-2-ylcyclopentane
CID 88998786

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine?
The IUPAC name of N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine (CID 81386494) is N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine.
What is the SMILES notation for N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine?
The canonical SMILES for N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine is COCC(N[C@@H](C)C1CCCC1)C1CC1.
What is the InChIKey of N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine?
The InChIKey is BEGWOLQDKJQHDF-NKUHCKNESA-N. The full InChI is InChI=1S/C13H25NO/c1-10(11-5-3-4-6-11)14-13(9-15-2)12-7-8-12/h10-14H,3-9H2,1-2H3/t10-,13?/m0/s1.
What are the key properties of N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine?
N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine has a molecular weight of 211.35 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine is sourced from PubChem (CID 81386494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).