4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide

C14H21N3O2 — CID 103989633

IUPAC4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide
SMILESCOC1(CNc2ccnc(C(=O)N(C)C)c2)CCC1
InChIInChI=1S/C14H21N3O2/c1-17(2)13(18)12-9-11(5-8-15-12)16-10-14(19-3)6-4-7-14/h5,8-9H,4,6-7,10H2,1-3H3,(H,15,16)
InChIKeyQPFDUVJWUGHUIG-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.76
Rot. Bonds5

About 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide

4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide (PubChem CID 103989633) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide
PubChem CID103989633
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide
SMILESCOC1(CNc2ccnc(C(=O)N(C)C)c2)CCC1
InChIInChI=1S/C14H21N3O2/c1-17(2)13(18)12-9-11(5-8-15-12)16-10-14(19-3)6-4-7-14/h5,8-9H,4,6-7,10H2,1-3H3,(H,15,16)
InChIKeyQPFDUVJWUGHUIG-UHFFFAOYSA-N
XLogP1.76
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43517479
N,N-dimethyl-4-[(2-oxo-2-piperidin-1-ylethyl)amino]pyridine-2-carboxamide
CID 115677825
2-[1-[[2-(dimethylcarbamoyl)-4-pyridinyl]amino]cyclobutyl]acetic acid
CID 79846030
4-[(2-amino-2-methylpropyl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 113282785
N,N-dimethyl-4-(3-pyrrolidin-1-ylpropylamino)pyridine-2-carboxamide
CID 60703987
N-ethyl-4-[(3-methoxyoxolan-3-yl)methylamino]pyridine-2-carboxamide
CID 104705688
N,N-dimethyl-4-(2-piperidin-1-ylpropylamino)pyridine-2-carboxamide
CID 61017944
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771
N,N-dimethyl-4-[[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxamide
CID 43395819
N,N-dimethyl-4-[2-[methyl(propan-2-yl)amino]ethylamino]pyridine-2-carboxamide
CID 62642740
4-[(1-methoxy-2-methylpropan-2-yl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 113470431
N,N-dimethyl-4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-2-carboxamide
CID 62992312

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide?
The IUPAC name of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide (CID 103989633) is 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide?
The canonical SMILES for 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide is COC1(CNc2ccnc(C(=O)N(C)C)c2)CCC1.
What is the InChIKey of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide?
The InChIKey is QPFDUVJWUGHUIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-17(2)13(18)12-9-11(5-8-15-12)16-10-14(19-3)6-4-7-14/h5,8-9H,4,6-7,10H2,1-3H3,(H,15,16).
What are the key properties of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide?
4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 103989633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).