5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine

C14H23ClN4 — CID 55174807

IUPAC5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine
SMILESCN1CCC(CN(C)Cc2nc(N)ccc2Cl)CC1
InChIInChI=1S/C14H23ClN4/c1-18-7-5-11(6-8-18)9-19(2)10-13-12(15)3-4-14(16)17-13/h3-4,11H,5-10H2,1-2H3,(H2,16,17)
InChIKeyUBZKYEJDSMQJJQ-UHFFFAOYSA-N
MW282.82 g/mol
LogP2.09
Rot. Bonds4

About 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine

5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine (PubChem CID 55174807) has the molecular formula C14H23ClN4 and a molecular weight of 282.82 g/mol. Its IUPAC name is 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine
PubChem CID55174807
Molecular FormulaC14H23ClN4
Molecular Weight282.82 g/mol
Exact Mass282.16
IUPAC Name5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine
SMILESCN1CCC(CN(C)Cc2nc(N)ccc2Cl)CC1
InChIInChI=1S/C14H23ClN4/c1-18-7-5-11(6-8-18)9-19(2)10-13-12(15)3-4-14(16)17-13/h3-4,11H,5-10H2,1-2H3,(H2,16,17)
InChIKeyUBZKYEJDSMQJJQ-UHFFFAOYSA-N
XLogP2.09
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.82
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-6-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-2-amine
CID 79312899
5-chloro-6-[[cyclopropylmethyl(ethyl)amino]methyl]pyridin-2-amine
CID 63956306
6-amino-3-chloro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2-carboxamide
CID 63235274
5-chloro-6-[(dimethylamino)methyl]pyridin-2-amine
CID 62893036
5-chloro-6-[[methyl(propyl)amino]methyl]pyridin-2-amine
CID 62890602
2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 63236440
N-[(2-chloropyrimidin-4-yl)methyl]-N-methyl-1-(1-methylpiperidin-4-yl)methanamine
CID 112751145
2-[(6-amino-3-chloro-2-pyridinyl)methyl-methylamino]-N,N-dimethylacetamide
CID 62892874
5-chloro-6-[(4-propylpiperidin-1-yl)methyl]pyridin-2-amine
CID 62892230
N-[(4-chloro-2-pyridinyl)methyl]-N-methyl-1-(1-methylpiperidin-4-yl)methanamine
CID 79255091
2-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]phenol
CID 112553641
5-chloro-6-[[cyclopropyl(propyl)amino]methyl]pyridin-2-amine
CID 62891822

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine (CID 55174807) is 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine is CN1CCC(CN(C)Cc2nc(N)ccc2Cl)CC1.
What is the InChIKey of 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine?
The InChIKey is UBZKYEJDSMQJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN4/c1-18-7-5-11(6-8-18)9-19(2)10-13-12(15)3-4-14(16)17-13/h3-4,11H,5-10H2,1-2H3,(H2,16,17).
What are the key properties of 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine?
5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine has a molecular weight of 282.82 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]pyridin-2-amine is sourced from PubChem (CID 55174807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).