trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine

C8H17NO — CID 130921581

IUPACtrans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine
SMILESCOCC(C)N[C@@H]1C[C@H]1C
InChIInChI=1S/C8H17NO/c1-6-4-8(6)9-7(2)5-10-3/h6-9H,4-5H2,1-3H3/t6-,7?,8-/m1/s1
InChIKeyQESIPLZOUHWIDR-OECOWPMFSA-N
MW143.23 g/mol
LogP1.02
Rot. Bonds4

About trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine

trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine (PubChem CID 130921581) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine.

Molecular Properties

Compound Nametrans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine
PubChem CID130921581
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Nametrans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine
SMILESCOCC(C)N[C@@H]1C[C@H]1C
InChIInChI=1S/C8H17NO/c1-6-4-8(6)9-7(2)5-10-3/h6-9H,4-5H2,1-3H3/t6-,7?,8-/m1/s1
InChIKeyQESIPLZOUHWIDR-OECOWPMFSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methoxypropan-2-yl)-2,3-dimethylcyclopentan-1-amine
CID 64907132
N-(1-methoxypropan-2-yl)-1,3-dimethylpiperidin-4-amine
CID 115664125
N-(1-methoxypropan-2-yl)-2,6-dimethylcyclohexan-1-amine
CID 13090556
cis-(1S,3R)-N-[(2S)-1-methoxypropan-2-yl]-3-methylcyclopentan-1-amine
CID 95368713
2-methoxy-N-(1-methoxypropan-2-yl)cyclohexan-1-amine
CID 2850085
cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine
CID 11871353
2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol
CID 60713672
1-methoxy-N-[(2-methylcyclopropyl)methyl]propan-2-amine
CID 115713098
tert-butyl N-[2-(1-methoxypropan-2-ylamino)cyclopropyl]carbamate
CID 107237881
N-(1-methoxyhexan-2-yl)-2-methylcyclopropan-1-amine
CID 115716811
2-(chloromethyl)-N-(1-methoxypropan-2-yl)cyclohexan-1-amine
CID 106365311
3-[(2-methylcyclopropyl)amino]butanenitrile
CID 62397925

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine?
The IUPAC name of trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine (CID 130921581) is trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine.
What is the SMILES notation for trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine?
The canonical SMILES for trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine is COCC(C)N[C@@H]1C[C@H]1C.
What is the InChIKey of trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine?
The InChIKey is QESIPLZOUHWIDR-OECOWPMFSA-N. The full InChI is InChI=1S/C8H17NO/c1-6-4-8(6)9-7(2)5-10-3/h6-9H,4-5H2,1-3H3/t6-,7?,8-/m1/s1.
What are the key properties of trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine?
trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-N-(1-methoxypropan-2-yl)-2-methylcyclopropan-1-amine is sourced from PubChem (CID 130921581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).