2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide

C9H18N2O2 — CID 93280771

IUPAC2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide
SMILESCO[C@H]1CCCC[C@@H]1NCC(N)=O
InChIInChI=1S/C9H18N2O2/c1-13-8-5-3-2-4-7(8)11-6-9(10)12/h7-8,11H,2-6H2,1H3,(H2,10,12)/t7-,8-/m0/s1
InChIKeyQRBKOPDLEIHDJB-YUMQZZPRSA-N
MW186.25 g/mol
LogP0.02
Rot. Bonds4

About 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide

2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide (PubChem CID 93280771) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide.

Molecular Properties

Compound Name2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide
PubChem CID93280771
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide
SMILESCO[C@H]1CCCC[C@@H]1NCC(N)=O
InChIInChI=1S/C9H18N2O2/c1-13-8-5-3-2-4-7(8)11-6-9(10)12/h7-8,11H,2-6H2,1H3,(H2,10,12)/t7-,8-/m0/s1
InChIKeyQRBKOPDLEIHDJB-YUMQZZPRSA-N
XLogP0.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1R,2R)-2-methoxycyclohexyl]amino]acetic acid
CID 93286937
ethyl 2-[(2-methoxycyclohexyl)amino]acetate
CID 60810510
2-[(2-methoxycyclohexyl)amino]-N,N-dimethylacetamide
CID 43775418
3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
CID 106274861
N-cycloheptyl-2-[(2-methoxycyclopentyl)amino]acetamide
CID 55085147
N,N-diethyl-2-[(2-methoxycyclopentyl)amino]acetamide
CID 62087512
trans-(1S,2S)-N-ethyl-2-methoxycyclohexan-1-amine
CID 93280859
N-(cyclopropylmethyl)-2-methoxycyclohexan-1-amine
CID 43756809
N-butan-2-yl-2-[(2-methoxycyclopentyl)amino]acetamide
CID 62087337
2-[(2-methoxycyclopentyl)amino]-N-pentan-2-ylacetamide
CID 62088034
2-[(2-methoxycyclopentyl)amino]-1-morpholin-4-ylethanone
CID 62086617
S-methyl N-[(1R,2S)-2-methoxycyclohexyl]carbamothioate
CID 41097231

Frequently Asked Questions

What is the IUPAC name of 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide?
The IUPAC name of 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide (CID 93280771) is 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide.
What is the SMILES notation for 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide?
The canonical SMILES for 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide is CO[C@H]1CCCC[C@@H]1NCC(N)=O.
What is the InChIKey of 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide?
The InChIKey is QRBKOPDLEIHDJB-YUMQZZPRSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-13-8-5-3-2-4-7(8)11-6-9(10)12/h7-8,11H,2-6H2,1H3,(H2,10,12)/t7-,8-/m0/s1.
What are the key properties of 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide?
2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide has a molecular weight of 186.25 g/mol, XLogP of 0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide is sourced from PubChem (CID 93280771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).