N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide

C13H24N2O2 — CID 113233568

IUPACN-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCCOCC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-11-4-7-15(8-5-11)13(16)14-6-9-17-10-12-2-3-12/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyMNHMNAUFTBCTAT-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.85
Rot. Bonds5

About N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide

N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide (PubChem CID 113233568) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide
PubChem CID113233568
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCCOCC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-11-4-7-15(8-5-11)13(16)14-6-9-17-10-12-2-3-12/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyMNHMNAUFTBCTAT-UHFFFAOYSA-N
XLogP1.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[(4-methylpiperidine-1-carbonyl)amino]ethoxy]acetic acid
CID 79457260
N-[3-(cyclopropylmethoxy)propyl]pyrrolidine-1-carboxamide
CID 52572173
4-methyl-N-(2-propan-2-yloxyethyl)piperidine-1-carboxamide
CID 104578083
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
4-methyl-N-(3-methylbutyl)piperidine-1-carboxamide
CID 51712124
N-decyl-4-methylpiperidine-1-carboxamide
CID 116656754
N-(3-hydroxybutyl)-4-methylpiperidine-1-carboxamide
CID 79160258
N-[2-(methanesulfinamido)ethyl]-4-methylpiperidine-1-carboxamide
CID 143816836
4-methyl-N-[2-(propylamino)ethyl]piperidine-1-carboxamide
CID 79163549
N-hexyl-4-methylpiperidine-1-carboxamide
CID 71899822
4-amino-N-(2-methoxyethyl)piperidine-1-carboxamide
CID 122417506
2-(cyclopropylmethoxy)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 115868513

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide (CID 113233568) is N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide is CC1CCN(C(=O)NCCOCC2CC2)CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide?
The InChIKey is MNHMNAUFTBCTAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-11-4-7-15(8-5-11)13(16)14-6-9-17-10-12-2-3-12/h11-12H,2-10H2,1H3,(H,14,16).
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide?
N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 113233568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).