(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one

C12H22N2O2 — CID 119337266

IUPAC(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one
SMILESC[C@@H](N)C(=O)N1CCC(OCC2CC2)CC1
InChIInChI=1S/C12H22N2O2/c1-9(13)12(15)14-6-4-11(5-7-14)16-8-10-2-3-10/h9-11H,2-8,13H2,1H3/t9-/m1/s1
InChIKeyUZJFNOBQYQIRCP-SECBINFHSA-N
MW226.32 g/mol
LogP0.75
Rot. Bonds4

About (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one

(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one (PubChem CID 119337266) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one
PubChem CID119337266
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one
SMILESC[C@@H](N)C(=O)N1CCC(OCC2CC2)CC1
InChIInChI=1S/C12H22N2O2/c1-9(13)12(15)14-6-4-11(5-7-14)16-8-10-2-3-10/h9-11H,2-8,13H2,1H3/t9-/m1/s1
InChIKeyUZJFNOBQYQIRCP-SECBINFHSA-N
XLogP0.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one;hydrochloride
CID 119337265
(2S)-2-amino-1-(4-propoxyazepan-1-yl)propan-1-one;hydrochloride
CID 119321485
(2S)-2-amino-1-(4-cyclopentyloxypiperidin-1-yl)propan-1-one
CID 119312938
[1-[(2S)-2-aminopropanoyl]piperidin-4-yl] acetate
CID 67663006
(2S)-2-amino-1-[4-(cyclopropylmethylamino)piperidin-1-yl]propan-1-one
CID 121230409
N-[[1-[(2S)-2-aminopropanoyl]piperidin-4-yl]methyl]acetamide
CID 66567593
(2R)-2-amino-1-(4-aminopiperidin-1-yl)propan-1-one;hydrochloride
CID 131089631
(2S)-2-amino-1-[4-(2-phenylethoxy)piperidin-1-yl]propan-1-one
CID 119299189
(2S)-2-amino-1-[4-[(dimethylamino)methyl]piperidin-1-yl]propan-1-one
CID 61148515
(2S)-2-amino-1-[(3R)-3-methoxypyrrolidin-1-yl]propan-1-one
CID 66564457
(2S)-2-amino-1-(4-chloropiperidin-1-yl)propan-1-one
CID 66564392
2-amino-1-(4-methylpiperidin-1-yl)propan-1-one
CID 18715079

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one?
The IUPAC name of (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one (CID 119337266) is (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one.
What is the SMILES notation for (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one?
The canonical SMILES for (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one is C[C@@H](N)C(=O)N1CCC(OCC2CC2)CC1.
What is the InChIKey of (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one?
The InChIKey is UZJFNOBQYQIRCP-SECBINFHSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9(13)12(15)14-6-4-11(5-7-14)16-8-10-2-3-10/h9-11H,2-8,13H2,1H3/t9-/m1/s1.
What are the key properties of (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one?
(2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one has a molecular weight of 226.32 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-[4-(cyclopropylmethoxy)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 119337266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).